2-oxidanyl-4-oxidanylidene-7-[3-(2,3,5-trimethylphenoxy)propoxy]chromene-3-carbonitrile

Systemtic Name: 2-oxidanyl-4-oxidanylidene-7-[3-(2,3,5-trimethylphenoxy)propoxy]chromene-3-carbonitrile Openeye Name: 2-hydroxy-4-oxo-7-[3-(2,3,5-trimethylphenoxy)propoxy]chromene-3-carbonitrile CAS Name: 2-hydroxy-4-oxo-7-[3-(2,3,5-trimethylphenoxy)propoxy]-1-benzopyran-3-carbonitrile IUPAC Name: 2-hydroxy-4-oxo-7-[3-(2,3,5-trimethylphenoxy)propoxy]chromene-3-carbonitrile Traditional Name: 2-hydroxy-4-keto-7-[3-(2,3,5-trimethylphenoxy)propoxy]chromene-3-carbonitrile Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)C#N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)C#N)C)C

InChI

InChI=1S/C22H21NO5/c1-13-9-14(2)15(3)19(10-13)27-8-4-7-26-16-5-6-17-20(11-16)28-22(25)18(12-23)21(17)24/h5-6,9-11,25H,4,7-8H2,1-3H3